UCSF

ZINC01394483

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 17th, 2004 18 No

Popular Name: 1-Boc-2,3-Dihydro-7-indolecarbaldehyde 1-Boc-2,3-Dihydro-7-indolecarbal…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 174539-67-4 , [174539-67-4]

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.81 2.14 -11.6 0 4 0 47 247.294 3 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 86 - 87 KeyOrganics
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )